3-Hydroxyquinine

CAS Registry Number®

78549-61-8

CAS Name

3-Hydroxyquinine

Molecular Formula

C20H24N2O3

Molecular Mass

340.42

Cite this Page

3-Hydroxyquinine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78549-61-8 (retrieved 2024-11-21) (CAS RN: 78549-61-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    148-150 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O3/c1-3-20(24)12-22-9-7-13(20)10-18(22)19(23)15-6-8-21-17-5-4-14(25-2)11-16(15)17/h3-6,8,11,13,18-19,23-24H,1,7,9-10,12H2,2H3/t13-,18-,19+,20+/m0/s1

InChIKey

InChIKey=BSRUJCFCZKMFMB-YGHPHNMRSA-N

SMILES

[C@@H](O)(C=1C2=C(C=CC(OC)=C2)N=CC1)[C@]3([N@@]4C[C@@](C=C)(O)[C@](C3)(CC4)[H])[H]

Canonical SMILES

OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(O)(C=C)C4

Other Names for this Substance

  • Cinchonan-3,9-diol, 6′-methoxy-, (8α,9R)-
  • (8α,9R)-6′-Methoxycinchonan-3,9-diol
  • 3-Hydroxyquinine
  • (3S)-Hydroxyquinine
  • (3S)-3-Hydroxyquinine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration